2-[5-sulfanylidene-4-[4-(trifluoromethyloxy)phenyl]-1H-1,2,4-triazol-3-yl]phenolate

Systemtic Name: 2-[5-sulfanylidene-4-[4-(trifluoromethyloxy)phenyl]-1H-1,2,4-triazol-3-yl]phenolate Openeye Name: 2-[5-thioxo-4-[4-(trifluoromethoxy)phenyl]-1H-1,2,4-triazol-3-yl]phenolate CAS Name: 2-[5-sulfanylidene-4-[4-(trifluoromethoxy)phenyl]-1H-1,2,4-triazol-3-yl]phenolate IUPAC Name: 2-[5-sulfanylidene-4-[4-(trifluoromethoxy)phenyl]-1H-1,2,4-triazol-3-yl]phenolate Traditional Name: 2-[5-thioxo-4-[4-(trifluoromethoxy)phenyl]-1H-1,2,4-triazol-3-yl]phenolate Formula: C15H9F3N3O2S- MolecularWeight: 352.31107

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NNC(=S)N2C3=CC=C(C=C3)OC(F)(F)F)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NNC(=S)N2C3=CC=C(C=C3)OC(F)(F)F)[O-]

InChI

InChI=1S/C15H10F3N3O2S/c16-15(17,18)23-10-7-5-9(6-8-10)21-13(19-20-14(21)24)11-3-1-2-4-12(11)22/h1-8,22H,(H,20,24)/p-1